CU5
Summary
Name: | S-Dihydrowogonin |
Formula: | C16 H14 O5 |
Formal charge: | 0 |
Formula weight: | 286.279 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | (2~{S})-8-methoxy-5,7-bis(oxidanyl)-2-phenyl-2,3-dihydrochromen-4-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C16H14O5/c1-20-15-12(19)7-10(17)14-11(18)8-13(21-16(14)15)9-5-3-2-4-6-9/h2-7,13,17,19H,8H2,1H3/t13-/m0/s1 |
InChIKey | InChI | 1.03 | FKAOWOSRYSMEBS-ZDUSSCGKSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1c(O)cc(O)c2C(=O)C[C@H](Oc12)c3ccccc3 |
SMILES | CACTVS | 3.385 | COc1c(O)cc(O)c2C(=O)C[CH](Oc12)c3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1c(cc(c2c1O[C@@H](CC2=O)c3ccccc3)O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | COc1c(cc(c2c1OC(CC2=O)c3ccccc3)O)O |